5-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3972-2235 |
| Compound Name: | 5-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 356.8 |
| Molecular Formula: | C13 H9 Cl N2 O4 S2 |
| Smiles: | C=CCN1C(/C(=C\c2cc(cc(c2O)[N+]([O-])=O)[Cl])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8115 |
| logD: | 1.7767 |
| logSw: | -4.0486 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.252 |
| InChI Key: | RUTURBIOEMKCSV-UHFFFAOYSA-N |